Application of explicitly correlated coupled-cluster methods to molecules containing post-3d main group elements
Author:
Affiliation:
1. a Department of Chemistry , Washington State University , Pullman , Washington 99164-4630 , USA
2. b Institut für Theoretische Chemie, Universität Stuttgart , Pfaffenwaldring 55, D-70569 Stuttgart , Germany
Publisher
Informa UK Limited
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics
Link
https://www.tandfonline.com/doi/pdf/10.1080/00268976.2011.624129
Reference71 articles.
1. A simple and efficient CCSD(T)-F12 approximation
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3. Communications: Accurate and efficient approximations to explicitly correlated coupled-cluster singles and doubles, CCSD-F12
4. Accurate calculation of vibrational frequencies using explicitly correlated coupled-cluster theory
5. Accurate Calculations of Intermolecular Interaction Energies Using Explicitly Correlated Coupled Cluster Wave Functions and a Dispersion-Weighted MP2 Method
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